4-(azocan-1-yl)-2-chloranyl-8-methylsulfanyl-pyrimido[5,4-d]pyrimidine

Systemtic Name: 4-(azocan-1-yl)-2-chloranyl-8-methylsulfanyl-pyrimido[5,4-d]pyrimidine Openeye Name: 4-(azocan-1-yl)-2-chloro-8-methylsulfanyl-pyrimido[5,4-d]pyrimidine CAS Name: 4-(1-azocanyl)-2-chloro-8-(methylthio)pyrimido[5,4-d]pyrimidine IUPAC Name: 4-(azocan-1-yl)-2-chloro-8-methylsulfanylpyrimido[5,4-d]pyrimidine Traditional Name: 4-(azocan-1-yl)-2-chloro-8-(methylthio)pyrimido[5,4-d]pyrimidine Formula: C14H18ClN5S MolecularWeight: 323.84422

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=NC2=C1N=C(N=C2N3CCCCCCC3)Cl

Isomeric SMILES

CSC1=NC=NC2=C1N=C(N=C2N3CCCCCCC3)Cl

InChI

InChI=1S/C14H18ClN5S/c1-21-13-11-10(16-9-17-13)12(19-14(15)18-11)20-7-5-3-2-4-6-8-20/h9H,2-8H2,1H3